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{
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"results": [
{
"id": "mp-11755",
"created_at": "2022-09-04T14:45:56.583710Z",
"structure_string": "Lu6 Sb2 Mo1\n1.0\n3.995158 -6.919816 0.000000\n3.995158 6.919816 0.000000\n0.000000 0.000000 4.300449\nLu Sb Mo\n6 2 1\ndirect\n0.609028 0.000000 0.500000 Lu\n0.390972 0.390972 0.500000 Lu\n0.000000 0.609028 0.500000 Lu\n0.000000 0.239271 0.000000 Lu\n0.760729 0.760729 0.000000 Lu\n0.239271 0.000000 0.000000 Lu\n0.666667 0.333333 0.000000 Sb\n0.333333 0.666667 0.000000 Sb\n0.000000 0.000000 0.500000 Mo\n",
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{
"id": "mp-1218835",
"created_at": "2022-09-04T14:39:05.575666Z",
"structure_string": "Sn2 Ge2 Se4\n1.0\n4.038015 0.000000 0.000000\n0.000000 4.572809 0.000000\n0.000000 0.000000 11.446384\nSn Ge Se\n2 2 4\ndirect\n0.500000 0.353142 0.385589 Sn\n0.500000 0.646858 0.885589 Sn\n0.000000 0.126519 0.625609 Ge\n0.000000 0.873481 0.125609 Ge\n0.000000 0.234500 0.845547 Se\n0.000000 0.765500 0.345547 Se\n0.500000 0.239518 0.143255 Se\n0.500000 0.760482 0.643255 Se\n",
"nsites": 8,
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"formula_full": "Sn2 Ge2 Se4",
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"spacegroup": 26
},
{
"id": "mp-1223265",
"created_at": "2022-09-04T14:42:01.935913Z",
"structure_string": "La2 Ge3\n1.0\n4.170893 0.000000 0.000000\n0.000000 4.313543 0.000000\n2.085447 2.156772 7.342243\nLa Ge\n2 3\ndirect\n0.750349 0.250349 0.499302 La\n0.000313 0.000313 0.999373 La\n0.408386 0.408386 0.183228 Ge\n0.178442 0.678442 0.643116 Ge\n0.577509 0.577509 0.844982 Ge\n",
"nsites": 5,
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"elements": [
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"density": 6.231651942136451,
"density_atomic": 0.03785106208606015,
"volume": 132.0966896155183,
"volume_molar": 15.91009717589363,
"formula_full": "La2 Ge3",
"formula_reduced": "La2Ge3",
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"energy": -27.36478029,
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"updated_at": "2021-11-28T01:35:43.036000Z",
"spacegroup": 44
},
{
"id": "mp-647590",
"created_at": "2022-09-04T14:42:49.426975Z",
"structure_string": "As20 Pb12 S40\n1.0\n7.705320 0.000000 0.000000\n0.000000 9.096060 0.000000\n0.000000 1.184479 27.140014\nAs Pb S\n20 12 40\ndirect\n0.650743 0.264726 0.592219 As\n0.500327 0.006598 0.320725 As\n0.190898 0.500087 0.811823 As\n0.713221 0.082118 0.183185 As\n0.842622 0.947034 0.905753 As\n0.005509 0.241544 0.177276 As\n0.000327 0.993402 0.679275 As\n0.505509 0.758456 0.822724 As\n0.842969 0.475860 0.905051 As\n0.150743 0.735274 0.407781 As\n0.662067 0.815052 0.598060 As\n0.299138 0.297194 0.690426 As\n0.213221 0.917882 0.816815 As\n0.782324 0.182744 0.317644 As\n0.162067 0.184948 0.401940 As\n0.342622 0.052966 0.094247 As\n0.342969 0.524140 0.094949 As\n0.799138 0.702806 0.309574 As\n0.282324 0.817256 0.682356 As\n0.690898 0.499913 0.188177 As\n0.551566 0.247323 0.826642 Pb\n0.942158 0.494695 0.670591 Pb\n0.753009 0.995317 0.462674 Pb\n0.051566 0.752677 0.173358 Pb\n0.279638 0.525827 0.540034 Pb\n0.442158 0.505305 0.329409 Pb\n0.737709 0.256628 0.037789 Pb\n0.230900 0.233559 0.962395 Pb\n0.237709 0.743372 0.962211 Pb\n0.779638 0.474173 0.459966 Pb\n0.253009 0.004683 0.537326 Pb\n0.730900 0.766441 0.037605 Pb\n0.617899 0.275286 0.378437 S\n0.672401 0.764413 0.937569 S\n0.534121 0.223708 0.132557 S\n0.958325 0.564575 0.361439 S\n0.421522 0.839988 0.261515 S\n0.321615 0.994932 0.435174 S\n0.034196 0.335282 0.855202 S\n0.034121 0.776292 0.867443 S\n0.921522 0.160012 0.738485 S\n0.534196 0.664718 0.144798 S\n0.493680 0.261770 0.521359 S\n0.868133 0.975144 0.123930 S\n0.006674 0.229765 0.472928 S\n0.765821 0.040130 0.787120 S\n0.821615 0.005068 0.564826 S\n0.265821 0.959870 0.212880 S\n0.119983 0.185865 0.634434 S\n0.178930 0.725867 0.074878 S\n0.458325 0.435425 0.638561 S\n0.501659 0.514965 0.024014 S\n0.172401 0.235587 0.062431 S\n0.088757 0.412437 0.235049 S\n0.368133 0.024856 0.876070 S\n0.963529 0.030000 0.363011 S\n0.997219 0.985500 0.977000 S\n0.749037 0.705567 0.717634 S\n0.506674 0.770235 0.527072 S\n0.249037 0.294433 0.282366 S\n0.463529 0.970000 0.636989 S\n0.329572 0.545465 0.429912 S\n0.588757 0.587563 0.764951 S\n0.497219 0.014500 0.023000 S\n0.117899 0.724714 0.621563 S\n0.993680 0.738230 0.478641 S\n0.001659 0.485035 0.975986 S\n0.619983 0.814135 0.365566 S\n0.892129 0.433267 0.130238 S\n0.678930 0.274133 0.925122 S\n0.392129 0.566733 0.869762 S\n0.829572 0.454535 0.570088 S\n",
"nsites": 72,
"nelements": 3,
"elements": [
"As",
"Pb",
"S"
],
"chemical_system": "As-Pb-S",
"density": 4.598264742558736,
"density_atomic": 0.03785109371990463,
"volume": 1902.1907407166307,
"volume_molar": 15.910083879116963,
"formula_full": "As20 Pb12 S40",
"formula_reduced": "As5Pb3S10",
"formula_anonymous": "A3B5C10",
"energy": -333.1711946,
"energy_per_atom": -4.627377702777777,
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"energy_uncorrected": -313.0511946,
"band_gap": 0.0551999999999996,
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"is_magnetic": true,
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"is_theoretical": false,
"updated_at": "2021-11-28T01:35:53.616000Z",
"spacegroup": 4
},
{
"id": "mp-1210283",
"created_at": "2022-09-04T14:41:56.014615Z",
"structure_string": "Rb3 Ta1 F12\n1.0\n7.426095 3.685978 0.000000\n-7.426095 3.685978 0.000000\n0.000000 0.655591 7.721398\nRb Ta F\n3 1 12\ndirect\n0.000000 0.000000 0.500000 Rb\n0.000000 0.500000 0.000000 Rb\n0.500000 0.000000 0.000000 Rb\n0.000000 0.000000 0.000000 Ta\n0.298233 0.143137 0.085935 F\n0.701767 0.856863 0.914065 F\n0.816286 0.983938 0.181478 F\n0.856863 0.701767 0.914065 F\n0.183714 0.016062 0.818522 F\n0.143137 0.298233 0.085935 F\n0.881691 0.604595 0.686474 F\n0.016062 0.183714 0.818522 F\n0.118309 0.395405 0.313526 F\n0.983938 0.816286 0.181478 F\n0.395405 0.118309 0.313526 F\n0.604595 0.881691 0.686474 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Rb",
"Ta",
"F"
],
"chemical_system": "F-Rb-Ta",
"density": 2.6136559156022,
"density_atomic": 0.03785130076751147,
"volume": 422.70674126298775,
"volume_molar": 15.909996850541328,
"formula_full": "Rb3 Ta1 F12",
"formula_reduced": "Rb3TaF12",
"formula_anonymous": "AB3C12",
"energy": -76.12973459,
"energy_per_atom": -4.758108411875,
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"updated_at": "2021-11-28T01:35:30.748000Z",
"spacegroup": 12
},
{
"id": "mp-1071777",
"created_at": "2022-09-04T14:44:59.056286Z",
"structure_string": "Sr2 Al4\n1.0\n4.489096 0.000000 0.000000\n0.000000 4.489096 0.000000\n0.000000 0.000000 7.865836\nSr Al\n2 4\ndirect\n0.500000 0.000000 0.325156 Sr\n0.000000 0.500000 0.674844 Sr\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.000000 Al\n0.000000 0.500000 0.204793 Al\n0.500000 0.000000 0.795207 Al\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sr",
"Al"
],
"chemical_system": "Al-Sr",
"density": 2.9663867124206162,
"density_atomic": 0.03785197784279549,
"volume": 158.51219254430592,
"volume_molar": 15.909712261300546,
"formula_full": "Sr2 Al4",
"formula_reduced": "SrAl2",
"formula_anonymous": "AB2",
"energy": -19.85173835,
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"energy_uncorrected": -19.85173835,
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"updated_at": "2021-11-28T01:36:48.135000Z",
"spacegroup": 129
},
{
"id": "mp-864973",
"created_at": "2022-09-04T14:39:47.914952Z",
"structure_string": "Dy2 Cd1 In1\n1.0\n0.000000 3.752322 3.752322\n3.752322 0.000000 3.752322\n3.752322 3.752322 0.000000\nDy Cd In\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Dy\n0.250000 0.250000 0.250000 Dy\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 In\n",
"nsites": 4,
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],
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"density": 8.678367008029557,
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"volume": 105.66479008792898,
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"formula_full": "Dy2 Cd1 In1",
"formula_reduced": "Dy2CdIn",
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"energy": -14.50968321,
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"updated_at": "2021-11-28T01:34:42.004000Z",
"spacegroup": 225
},
{
"id": "mp-1021747",
"created_at": "2022-09-04T14:43:59.406659Z",
"structure_string": "Rb1 Mg6 V1\n1.0\n5.662390 -5.671865 0.000000\n5.662390 5.671865 0.000000\n0.000000 0.000000 3.290048\nRb Mg V\n1 6 1\ndirect\n0.621690 0.621690 0.500000 Rb\n0.633849 0.124948 0.500000 Mg\n0.124948 0.633849 0.500000 Mg\n0.926049 0.333278 0.000000 Mg\n0.333278 0.926049 0.000000 Mg\n0.323446 0.323446 0.000000 Mg\n0.917984 0.917984 0.000000 Mg\n0.118751 0.118751 0.500000 V\n",
"nsites": 8,
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"elements": [
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],
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"density": 2.2177300969348064,
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"formula_full": "Rb1 Mg6 V1",
"formula_reduced": "RbMg6V",
"formula_anonymous": "ABC6",
"energy": -17.10290508,
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},
{
"id": "mp-638022",
"created_at": "2022-09-04T14:44:26.584700Z",
"structure_string": "Sb32 Pb40 S88\n1.0\n23.850824 0.000000 0.000000\n0.000000 8.161898 0.000000\n0.000000 4.000721 21.711562\nSb Pb S\n32 40 88\ndirect\n0.731439 0.656439 0.438350 Sb\n0.231439 0.843561 0.061650 Sb\n0.620356 0.620633 0.015138 Sb\n0.062269 0.362100 0.969114 Sb\n0.716231 0.566051 0.613364 Sb\n0.043821 0.482969 0.790428 Sb\n0.604641 0.944400 0.375961 Sb\n0.104641 0.555600 0.124039 Sb\n0.120356 0.879367 0.484862 Sb\n0.879644 0.120633 0.515138 Sb\n0.465321 0.481134 0.281723 Sb\n0.937731 0.637900 0.030886 Sb\n0.965321 0.018866 0.218277 Sb\n0.534679 0.518866 0.718277 Sb\n0.562269 0.137900 0.530886 Sb\n0.437731 0.862100 0.469114 Sb\n0.456179 0.982969 0.290428 Sb\n0.309527 0.937645 0.369538 Sb\n0.956179 0.517031 0.209572 Sb\n0.809527 0.562355 0.130462 Sb\n0.190473 0.437645 0.869538 Sb\n0.690473 0.062355 0.630462 Sb\n0.768561 0.156439 0.938350 Sb\n0.543821 0.017031 0.709572 Sb\n0.268561 0.343561 0.561650 Sb\n0.395359 0.055600 0.624039 Sb\n0.034679 0.981134 0.781723 Sb\n0.283769 0.433949 0.386636 Sb\n0.783769 0.066051 0.113364 Sb\n0.379644 0.379367 0.984862 Sb\n0.895359 0.444400 0.875961 Sb\n0.216231 0.933949 0.886636 Sb\n0.839782 0.281779 0.691827 Pb\n0.069595 0.897210 0.953010 Pb\n0.677519 0.730187 0.791308 Pb\n0.930405 0.102790 0.046990 Pb\n0.838646 0.774108 0.693530 Pb\n0.661354 0.274108 0.193530 Pb\n0.569595 0.602790 0.546990 Pb\n0.500231 0.179539 0.877181 Pb\n0.094935 0.072144 0.131073 Pb\n0.233020 0.356659 0.040379 Pb\n0.161354 0.225892 0.306470 Pb\n0.266980 0.856659 0.540379 Pb\n0.322481 0.269813 0.208692 Pb\n0.999840 0.186947 0.388702 Pb\n0.499769 0.820461 0.122819 Pb\n0.160218 0.718221 0.308173 Pb\n0.999769 0.679539 0.377181 Pb\n0.430405 0.397210 0.453010 Pb\n0.766980 0.643341 0.959621 Pb\n0.000231 0.320461 0.622819 Pb\n0.339782 0.218221 0.808173 Pb\n0.674965 0.226728 0.795058 Pb\n0.338646 0.725892 0.806470 Pb\n0.500160 0.686947 0.888702 Pb\n0.365024 0.881801 0.985975 Pb\n0.594935 0.427856 0.368927 Pb\n0.822481 0.230187 0.291308 Pb\n0.177519 0.769813 0.708692 Pb\n0.865024 0.618199 0.514025 Pb\n0.634976 0.118199 0.014025 Pb\n0.660218 0.781779 0.191827 Pb\n0.174965 0.273272 0.704942 Pb\n0.825035 0.726728 0.295058 Pb\n0.325035 0.773272 0.204942 Pb\n0.905065 0.927856 0.868927 Pb\n0.000160 0.813053 0.611298 Pb\n0.499840 0.313053 0.111298 Pb\n0.733020 0.143341 0.459621 Pb\n0.405065 0.572144 0.631073 Pb\n0.134976 0.381801 0.485975 Pb\n0.914643 0.555508 0.631940 S\n0.444321 0.141479 0.014073 S\n0.633917 0.370406 0.488938 S\n0.911841 0.972501 0.314406 S\n0.908314 0.064848 0.626150 S\n0.251181 0.483428 0.278264 S\n0.973251 0.757323 0.754737 S\n0.280224 0.689364 0.919129 S\n0.588159 0.472501 0.814406 S\n0.328564 0.286459 0.656187 S\n0.375002 0.734472 0.332728 S\n0.472862 0.267601 0.748383 S\n0.439407 0.601806 0.011278 S\n0.408314 0.435152 0.873850 S\n0.249471 0.987978 0.276790 S\n0.527138 0.732399 0.251617 S\n0.751181 0.016572 0.221736 S\n0.793209 0.447020 0.402179 S\n0.375255 0.185093 0.326918 S\n0.750529 0.012022 0.723210 S\n0.473251 0.742677 0.745263 S\n0.780224 0.810636 0.580871 S\n0.972862 0.232399 0.751617 S\n0.987164 0.171642 0.935007 S\n0.055679 0.641479 0.514073 S\n0.171436 0.786459 0.156187 S\n0.327274 0.813886 0.654346 S\n0.875255 0.314907 0.173082 S\n0.719776 0.310636 0.080871 S\n0.480945 0.851691 0.571372 S\n0.091686 0.935152 0.373850 S\n0.671436 0.713541 0.343813 S\n0.828564 0.213541 0.843813 S\n0.295383 0.605992 0.094326 S\n0.672726 0.186114 0.345654 S\n0.584300 0.969773 0.813427 S\n0.085357 0.444492 0.368060 S\n0.411841 0.527499 0.185594 S\n0.980945 0.648309 0.928628 S\n0.124998 0.234472 0.832728 S\n0.749471 0.512022 0.223210 S\n0.206791 0.552980 0.597821 S\n0.084300 0.530227 0.686573 S\n0.276602 0.156331 0.916783 S\n0.866083 0.870406 0.988938 S\n0.414643 0.944492 0.868060 S\n0.939407 0.898194 0.488722 S\n0.223398 0.656331 0.416783 S\n0.723398 0.843669 0.083217 S\n0.248819 0.983428 0.778264 S\n0.133917 0.129594 0.011062 S\n0.293209 0.052980 0.097821 S\n0.915700 0.469773 0.313427 S\n0.860577 0.389407 0.982163 S\n0.012836 0.828358 0.064993 S\n0.026749 0.242677 0.245263 S\n0.219776 0.189364 0.419129 S\n0.415700 0.030227 0.186573 S\n0.519055 0.148309 0.428628 S\n0.366083 0.629594 0.511062 S\n0.487164 0.328358 0.564993 S\n0.360577 0.110593 0.517837 S\n0.624998 0.265528 0.667272 S\n0.512836 0.671642 0.435007 S\n0.250529 0.487978 0.776790 S\n0.776602 0.343669 0.583217 S\n0.875002 0.765528 0.167272 S\n0.555679 0.858521 0.985927 S\n0.827274 0.686114 0.845654 S\n0.560593 0.398194 0.988722 S\n0.019055 0.351691 0.071372 S\n0.172726 0.313886 0.154346 S\n0.639423 0.889407 0.482163 S\n0.706791 0.947020 0.902179 S\n0.204617 0.105992 0.594326 S\n0.526749 0.257323 0.254737 S\n0.624745 0.814907 0.673082 S\n0.944321 0.358521 0.485927 S\n0.027138 0.767601 0.248383 S\n0.704617 0.394008 0.905674 S\n0.795383 0.894008 0.405674 S\n0.585357 0.055508 0.131940 S\n0.088159 0.027499 0.685594 S\n0.124745 0.685093 0.826918 S\n0.060593 0.101806 0.511278 S\n0.748819 0.516572 0.721736 S\n0.591686 0.564848 0.126150 S\n0.139423 0.610593 0.017837 S\n",
"nsites": 160,
"nelements": 3,
"elements": [
"Sb",
"Pb",
"S"
],
"chemical_system": "Pb-S-Sb",
"density": 5.895621274928444,
"density_atomic": 0.03785596860734932,
"volume": 4226.5461930074025,
"volume_molar": 15.908035064332942,
"formula_full": "Sb32 Pb40 S88",
"formula_reduced": "Sb4Pb5S11",
"formula_anonymous": "A4B5C11",
"energy": -750.54174579,
"energy_per_atom": -4.6908859111875,
"energy_above_hull": null,
"is_stable": null,
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"updated_at": "2021-11-28T01:36:35.016000Z",
"spacegroup": 14
},
{
"id": "mp-1028231",
"created_at": "2022-09-04T14:42:16.015062Z",
"structure_string": "Cs1 Ca1 Mg14\n1.0\n6.652464 -0.014054 0.000000\n-3.338403 5.782283 0.000000\n0.000000 0.000000 11.001023\nCs Ca Mg\n1 1 14\ndirect\n0.162008 0.831003 0.125000 Cs\n0.179192 0.339595 0.125000 Ca\n0.157718 0.328858 0.625000 Mg\n0.163053 0.831526 0.625000 Mg\n0.665977 0.330736 0.125000 Mg\n0.671558 0.333437 0.625000 Mg\n0.665977 0.835240 0.125000 Mg\n0.671558 0.838120 0.625000 Mg\n0.342711 0.177361 0.400269 Mg\n0.342711 0.177361 0.849731 Mg\n0.342711 0.665351 0.400269 Mg\n0.342711 0.665351 0.849731 Mg\n0.828826 0.164413 0.377601 Mg\n0.828826 0.164413 0.872399 Mg\n0.817232 0.658617 0.394044 Mg\n0.817232 0.658617 0.855956 Mg\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Cs",
"Ca",
"Mg"
],
"chemical_system": "Ca-Cs-Mg",
"density": 2.016489961107504,
"density_atomic": 0.037856030298197015,
"volume": 422.65393053539583,
"volume_molar": 15.908009140321349,
"formula_full": "Cs1 Ca1 Mg14",
"formula_reduced": "CsCaMg14",
"formula_anonymous": "ABC14",
"energy": -22.68828229,
"energy_per_atom": -1.418017643125,
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"formation_energy": null,
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"energy_uncorrected": -22.68828229,
"band_gap": 0.0,
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"total_magnetization": 9.91e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:40.898000Z",
"spacegroup": 38
},
{
"id": "mp-1181047",
"created_at": "2022-09-04T14:44:14.224682Z",
"structure_string": "Ho10 Sb2 Au4\n1.0\n-4.042807 4.042807 6.464849\n4.042807 -4.042807 6.464849\n4.042807 4.042807 -6.464849\nHo Sb Au\n10 2 4\ndirect\n0.500000 0.500000 0.000000 Ho\n0.000000 0.000000 0.000000 Ho\n0.514572 0.014572 0.813501 Ho\n0.201072 0.701072 0.186499 Ho\n0.014572 0.201072 0.500000 Ho\n0.701072 0.514572 0.500000 Ho\n0.485428 0.985428 0.186499 Ho\n0.798928 0.298928 0.813501 Ho\n0.985428 0.798928 0.500000 Ho\n0.298928 0.485428 0.500000 Ho\n0.250000 0.250000 0.000000 Sb\n0.750000 0.750000 0.000000 Sb\n0.136534 0.636534 0.773069 Au\n0.863466 0.363466 0.226931 Au\n0.636534 0.863466 0.500000 Au\n0.363466 0.136534 0.500000 Au\n",
"nsites": 16,
"nelements": 3,
"elements": [
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"Sb",
"Au"
],
"chemical_system": "Au-Ho-Sb",
"density": 10.532008768940235,
"density_atomic": 0.03785607539067659,
"volume": 422.6534270887618,
"volume_molar": 15.907990191405757,
"formula_full": "Ho10 Sb2 Au4",
"formula_reduced": "Ho5SbAu2",
"formula_anonymous": "AB2C5",
"energy": -79.37839171,
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"updated_at": "2021-11-28T01:36:31.015000Z",
"spacegroup": 140
},
{
"id": "mp-1192445",
"created_at": "2022-09-04T14:43:20.986960Z",
"structure_string": "Yb4 Er8 Se16\n1.0\n4.015596 0.000000 0.000000\n0.000000 13.427228 0.000000\n0.000000 0.000000 13.717430\nYb Er Se\n4 8 16\ndirect\n0.250000 0.370844 0.581921 Yb\n0.250000 0.870844 0.918079 Yb\n0.750000 0.629156 0.418079 Yb\n0.750000 0.129156 0.081921 Yb\n0.250000 0.108076 0.417715 Er\n0.250000 0.608076 0.082285 Er\n0.750000 0.891924 0.582285 Er\n0.750000 0.391924 0.917715 Er\n0.250000 0.148301 0.795739 Er\n0.250000 0.648301 0.704261 Er\n0.750000 0.851699 0.204261 Er\n0.750000 0.351699 0.295739 Er\n0.250000 0.214303 0.235677 Se\n0.250000 0.714303 0.264323 Se\n0.750000 0.785697 0.764323 Se\n0.750000 0.285697 0.735677 Se\n0.250000 0.255699 0.974626 Se\n0.250000 0.755699 0.525374 Se\n0.750000 0.744301 0.025374 Se\n0.750000 0.244301 0.474626 Se\n0.250000 0.469878 0.382277 Se\n0.250000 0.969878 0.117723 Se\n0.750000 0.530122 0.617723 Se\n0.750000 0.030122 0.882277 Se\n0.250000 0.034803 0.617978 Se\n0.250000 0.534803 0.882022 Se\n0.750000 0.965197 0.382022 Se\n0.750000 0.465197 0.117978 Se\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Yb",
"Er",
"Se"
],
"chemical_system": "Er-Se-Yb",
"density": 7.394516246466183,
"density_atomic": 0.03785723598138516,
"volume": 739.6208221267904,
"volume_molar": 15.907502499551622,
"formula_full": "Yb4 Er8 Se16",
"formula_reduced": "Yb(ErSe2)2",
"formula_anonymous": "AB2C4",
"energy": -160.196115,
"energy_per_atom": -5.721289821428571,
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"total_magnetization": 0.0034,
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"updated_at": "2021-11-28T01:36:19.233000Z",
"spacegroup": 62
}
]
}